Chem
J-GLOBAL ID:200907090936059642   Nikkaji number:J2.113.185G

9-[5-[1-[2-(2,3-Butanoquinoline-4-ylamino)ethyl]-1H-1,2,3-triazole-5-yl]pentyl]-2,7-diamino-10-phenyl-9-azoniaphenanthrene

9-[5-[1-[2-(2,3-ブタノキノリン-4-イルアミノ)エチル]-1H-1,2,3-トリアゾール-5-イル]ペンチル]-2,7-ジアミノ-10-フェニル-9-アゾニアフェナントレン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C41H43N7[N+]
Molecular formula furigana: C41-H43-N8
Molecular weight: 647.850
InChI: InChI=1S/C41H42N8/c42-29-18-20-32-33-21-19-30(43)26-39(33)48(41(36(32)25-29)28-11-3-1-4-12-28)23-10-2-5-13-31-27-45-47-49(31)24-22-44-40-34-14-6-8-16-37(34)46-38-17-9-7-15-35(38)40/h1,3-4,6,8,11-12,14,16,18-21,25-27,43H,2,5,7,9-10,13,15,17,22-24,42H2,(H,44,46)/p+1
InChI key: ALUZXISFDWHPFA-UHFFFAOYSA-O
SMILES: Nc1ccc2c(c1)c(c1ccccc1)[n+](CCCCCc1cnnn1CCNc1c3CCCCc3nc3ccccc13)c1cc(N)ccc21
Systematic name  (4):
  • 6-フェニル-3,8-ジアミノ-5-[5-[1-[2-[(1,2,3,4-テトラヒドロアクリジン-9-イル)アミノ]エチル]-1H-1,2,3-トリアゾール-5-イル]ペンチル]フェナントリジン-5-イウム
  • 9-[5-[1-[2-(2,3-ブタノキノリン-4-イルアミノ)エチル]-1H-1,2,3-トリアゾール-5-イル]ペンチル]-2,7-ジアミノ-10-フェニル-9-アゾニアフェナントレン
  • 3,8-ジアミノ-6-フェニル-5-[5-(1-{2-[(1,2,3,4-テトラヒドロアクリジン-9-イル)アミノ]エチル}-1H-1,2,3-トリアゾール-5-イル)ペンチル]フェナントリジン-5-イウム
  • 3,8-diamino-6-phenyl-5-[5-(1-{2-[(1,2,3,4-tetrahydroacridin-9-yl)amino]ethyl}-1H-1,2,3-triazol-5-yl)pentyl]phenanthridin-5-ium
Other name (2):
  • 6-Phenyl-3,8-diamino-5-[5-[1-[2-[(1,2,3,4-tetrahydroacridine-9-yl)amino]ethyl]-1H-1,2,3-triazole-5-yl]pentyl]phenanthridine-5-ium
  • 9-[5-[1-[2-(2,3-Butanoquinoline-4-ylamino)ethyl]-1H-1,2,3-triazole-5-yl]pentyl]-2,7-diamino-10-phenyl-9-azoniaphenanthrene
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